Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 6/20 | 0.46 |
| ▸ | CA1 | P00915 | 4/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1759482 | 0.87 | ALDH1A1 (0.56) | ALDH1A1CA2CA1ATMTSHR | |
| SCHEMBL6740278 | 0.86 | ALDH1A1 (0.50) | ALDH1A1CA2CA1ATMTSHR | |
| SCHEMBL4848334 | 0.85 | ALDH1A1 (0.54) | ALDH1A1CA2CA1ATMTSHR | |
| SCHEMBL120636 | 0.82 | CA2 (0.68) | ALDH1A1CA2CA1ATMTSHR | |
| SCHEMBL304869 | 0.82 | CA2 (0.68) | ALDH1A1CA2CA1ATMTSHR | |
| SCHEMBL6740281 | 0.82 | ALDH1A1 (0.50) | ALDH1A1CA2CA1ATMTSHR | |
| SCHEMBL7219212 | 0.82 | CA2 (0.57) | ALDH1A1CA2CA1ATMTSHR | |
| SCHEMBL1477902 | 0.82 | CA2 (0.68) | ALDH1A1CA2CA1ATMTSHR | |
| SCHEMBL6050223 | 0.81 | NAAA (0.54) | ALDH1A1CA2CA1ATMTSHR | |
| SCHEMBL6739242 | 0.80 | ALDH1A1 (0.48) | ALDH1A1CA2CA1ATMTSHR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016100578-A2 | ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS | MICURX PHARMACEUTICALS, INC. (US) | 2016-06-23 | — | — | WO | disclosed |